Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC16A3 | O15427 | 9/20 | 0.47 |
| ▸ | SLC16A1 | P53985 | 6/20 | 0.47 |
| ▸ | MCTS1 | Q9ULC4 | 5/20 | 0.47 |
| ▸ | PPARA | Q07869 | 8/20 | 0.45 |
| ▸ | PPARG | P37231 | 6/20 | 0.45 |
| ▸ | PPARD | Q03181 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9832364 | 0.89 | HSD17B10 (0.43) | SLC16A3SLC16A1MCTS1PPARAPPARG | |
| SCHEMBL9833217 | 0.88 | HSD17B10 (0.44) | PPARAPPARGPPARDHSD17B10TARBP2 | |
| Romazarit SCHEMBL43265 | 0.86 | ALDH1A1 (0.50) | SLC16A3SLC16A1MCTS1PPARAPPARG | |
| Romazarit SCHEMBL3226211 | 0.85 | ALDH1A1 (0.49) | SLC16A3SLC16A1MCTS1PPARAPPARG | |
| SCHEMBL9830013 | 0.83 | PPARA (0.57) | SLC16A3SLC16A1MCTS1PPARAPPARG | |
| SCHEMBL9830056 | 0.77 | PPARA (0.50) | SLC16A3SLC16A1MCTS1PPARAPPARG | |
| SCHEMBL9832600 | 0.76 | TARBP2 (0.51) | PPARAPPARGPPARDHSD17B10TARBP2 | |
| SCHEMBL10708196 | 0.76 | PPARD (0.47) | SLC16A3SLC16A1MCTS1PPARAPPARG | |
| SCHEMBL9834911 | 0.76 | HSD17B10 (0.48) | PPARAHSD17B10TARBP2ALDH1A1LMNA | |
| SCHEMBL10712401 | 0.75 | ALDH1A1 (0.49) | PPARAPPARGPPARDHSD17B10TARBP2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0220573-B1 | HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-12-11 | — | — | EP | claimed |
| US-4774253-A | ETHER,-ACIDS, ESTERS OR AMIDES | HOFFMANN-LA ROCHE INC. (US) | 1988-09-27 | — | — | US | claimed |
| EP-0220573-A1 | Heterocyclic compounds | F. HOFFMANN-LA ROCHE AG (CH) | 1987-05-06 | — | — | EP | claimed |
| EP-0220573-B1 | HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-12-11 | — | — | EP | disclosed |
| US-4774253-A | ETHER,-ACIDS, ESTERS OR AMIDES | HOFFMANN-LA ROCHE INC. (US) | 1988-09-27 | — | — | US | disclosed |
| EP-0220573-A1 | Heterocyclic compounds | F. HOFFMANN-LA ROCHE AG (CH) | 1987-05-06 | — | — | EP | disclosed |